canSAR938439
FEATURES
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NAMES
    SMILES
    Cl.O=S(=O)(c1cccc2ccccc12)c1n[nH]c2cccc(NCC3CCNCC3)c12
    InChI
    InChI=1S/C23H24N4O2S.ClH/c28-30(29,21-10-3-6-17-5-1-2-7-18(17)21)23-22-19(8-4-9-20(22)26-27-23)25-15-16-11-13-24-14-12-16;/h1-10,16,24-25H,11-15H2,(H,26,27);1H
    MOLECULAR FORMULA
    C23H25ClN4O2S
    CROSS REFERENCES
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    canSAR938439
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight456.14
    AlogP4.38
    HBond donors3
    HBond acceptors6
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR938439.